Found 7 results

Search term: VWINOFLMOJPXGV (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (3S,7S,10E,12S)-12-[(1S,3R,4E,6E)-1-Hydroxy-3,5-dimethyl(1,2,3,4,5,6,8,9-~13~C_8_)-4,6-nonadien-1-yl]-7-methyl-3-(~13~C)methyl(4,5,7,8,9,10,11,12-~13~C_8_)oxacyclododec-10-ene-2,6-dione | C713C17H38O4

(3S,7S,10E,12S)-12-[(1S,3R,4E,6E)-1-Hydroxy-3,5-dimethyl(1,2,3,4,5,6,8,9-13C8)-4,6-nonadien-1-yl]-7-methyl-3-(13C)methyl(4,5,7,8,9,10,11,12-13C8)oxacyclododec-10-ene-2,6-dione

  • Molecular FormulaC713C17H38O4
  • Average mass407.431 Da
  • Monoisotopic mass407.334045 Da
  • ChemSpider ID9157604

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 5 of 5 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(3S,7S,10E,12S)-12-[(1S,3R,4E,6E)-1-Hydroxy-3,5-dimethyl(1,2,3,4,5,6,8,9-13C8)-4,6-nonadien-1-yl]-7-methyl-3-(13C)methyl(4,5,7,8,9,10,11,12-13C8)oxacyclododec-10-en-2,6-dion [German] [ACD/IUPAC Name]
(3S,7S,10E,12S)-12-[(1S,3R,4E,6E)-1-Hydroxy-3,5-dimethyl(1,2,3,4,5,6,8,9-13C8)-4,6-nonadien-1-yl]-7-methyl-3-(13C)methyl(4,5,7,8,9,10,11,12-13C8)oxacyclododec-10-ene-2,6-dione [ACD/IUPAC Name]
(3S,7S,10E,12S)-12-[(1S,3R,4E,6E)-1-Hydroxy-3,5-diméthyl(1,2,3,4,5,6,8,9-13C8)-4,6-nonadién-1-yl]-7-méthyl-3-(13C)méthyl(4,5,7,8,9,10,11,12-13C8)oxacyclododéc-10-ène-2,6-dione [French] [ACD/IUPAC Name]
Oxacyclododec-10-ene-2,6-dione-4,5,7,8,9,10,11,12-13C8, 12-[(1S,3R,4E,6E)-1-hydroxy-3,5-dimethyl-4,6-nonadien-1-yl-1,2,3,4,5,6,8,9-13C8]-7-methyl-3-(methyl-13C)-, (3S,7S,10E,12S)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.483
Molar Refractivity: 114.0±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 45.2±0.5 10-24cm3
Surface Tension: 33.2±3.0 dyne/cm
Molar Volume: 399.3±3.0 cm3

Click to predict properties on the Chemicalize site


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